Version2.0 2020-02-07T10:38:06Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 30-Nov-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCC[NH+](CCNC(=O)[C@@H]1CCCN(C1)c2c3c(ncn2)n4c(n3)CCCCC4)Cc5ccco5 C09211116 RHF 6-31G(d) (6D,7F) CCCC[NH+](CCNC(=O)[C@@H]1CCCN(C1)c2c3c(ncn2)n4c(n3)CCCCC4)Cc5ccco5 C01[X(C27H40N7O2)] 222 C1 620 CCCC[NH+](Cc1ccco1)CCNC(=O)[C@@H]1CCCN(C1)c1ncnc2c1nc1n2CCCCC1 CCCC[NH+](Cc1ccco1)CCNC(=O)[C@@H]1CCCN(C1)c1ncnc2c1nc1n2CCCCC1 CCCC[NH+](CCNC(=O)[C@@H]1CCCN(C1)c2ncnc3n4CCCCCc4nc23)Cc5occc5 InChIKey=UHWRADIRDBKSEV-OAQYLSRUSA-O InChI=1S/C27H39N7O2/c1-2-3-13-32(19-22-10-8-17-36-22)16-12-28-27(35)21-9-7-14-33(18-21)25-24-26(30-20-29-25)34-15-6-4-5-11-23(34)31-24/h8,10,17,20-21H,2-7,9,11-16,18-19H2,1H3,(H,28,35)/p+1/t21-/m1/s1 InChI=1/C27H39N7O2/c1-2-3-13-32(19-22-10-8-17-36-22)16-12-28-27(35)21-9-7-14-33(18-21)25-24-26(30-20-29-25)34-15-6-4-5-11-23(34)31-24/h8,10,17,20-21H,2-7,9,11-16,18-19H2,1H3,(H,28,35)/p+1/t21-/m1/s1/fC27H40N7O2/h28,32H/q+1 CCCC[NH+](CCNC(=O)[C@@H]1CCCN(C1)c2c3c(ncn2)n4c(n3)CCCCC4)Cc5ccco5 C01[X(C27H40N7O2)] 222 C01 620 CCCC[NH+](Cc1ccco1)CCNC(=O)[C@@H]1CCCN(C1)c1ncnc2c1nc1n2CCCCC1 CCCC[NH](Cc1ccco1)CCNC(=O)[C@@H]1CCCN(C1)c1ncnc2c1nc1n2CCCCC1 CCCC[NH](CCNC(=O)[C@@H]1CCCN(C1)c2ncnc3n4CCCCCc4nc23)Cc5occc5 InChIKey=SSTQRJOBRLCVRZ-OAQYLSRUSA-N InChI=1S/C27H40N7O2/c1-2-3-13-32(19-22-10-8-17-36-22)16-12-28-27(35)21-9-7-14-33(18-21)25-24-26(30-20-29-25)34-15-6-4-5-11-23(34)31-24/h8,10,17,20-21,32H,2-7,9,11-16,18-19H2,1H3,(H,28,35)/t21-/m1/s1 InChI=1/C27H40N7O2/c1-2-3-13-32(19-22-10-8-17-36-22)16-12-28-27(35)21-9-7-14-33(18-21)25-24-26(30-20-29-25)34-15-6-4-5-11-23(34)31-24/h8,10,17,20-21,32H,2-7,9,11-16,18-19H2,1H3,(H,28,35)/t21-/m1/s1/f/h28H 3766.1441627517 -1576.4442966 1-A 35369.5148 133 487 620 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.74891 -20.63718 -15.83154 -15.69964 -15.67669 -15.64970 -15.61370 -15.61244 -15.60518 -11.45166 -11.42619 -11.42270 -11.41919 -11.40987 -11.40780 -11.39860 -11.39353 -11.36716 -11.36449 -11.36225 -11.36154 -11.35244 -11.33806 -11.33588 -11.33445 -11.32880 -11.32186 -11.31611 -11.30887 -11.30459 -11.29726 -11.29239 -11.28859 -11.28659 -11.28317 -11.27952 -1.59067 -1.50407 -1.46908 -1.43033 -1.37630 -1.35217 -1.33312 -1.26525 -1.23105 -1.21954 -1.20707 -1.19097 -1.17178 -1.15967 -1.14865 -1.11175 -1.10796 -1.10207 -1.08313 -1.06176 -1.03097 -1.02271 -1.01054 -0.97914 -0.96484 -0.95023 -0.93343 -0.93023 -0.92767 -0.91168 -0.89901 -0.89344 -0.86961 -0.86670 -0.84528 -0.83455 -0.82742 -0.81874 -0.81281 -0.80259 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1598.29 1609.39 1621.70 1630.17 1633.51 1690.23 1705.65 1716.41 1732.52 1744.23 1764.65 1773.37 1801.46 1805.77 1841.33 1845.55 1851.00 1871.61 1871.90 1907.97 1915.67 1945.03 1948.72 1953.70 1956.80 1960.32 1965.82 1984.40 1996.65 2002.22 2017.00 2037.02 2039.24 2055.60 2075.33 2080.32 2082.85 2087.82 2105.48 2119.94 2132.23 2136.03 2155.72 2158.20 2166.76 2176.18 2189.36 2191.21 2192.52 2205.93 2214.44 2215.67 2221.28 2238.16 2244.52 2255.75 2262.64 2265.22 2271.03 2274.56 2277.93 2306.63 2324.42 2339.42 2340.85 2348.06 2350.16 2351.57 2353.20 2362.71 2364.41 2367.71 2369.52 2373.88 2374.32 2376.47 2380.68 2386.72 2389.21 2403.77 2412.19 2433.34 2436.16 2509.65 2574.13 2592.30 2612.83 2774.33 4599.35 4609.25 4609.38 4611.96 4613.53 4618.36 4623.81 4624.78 4635.16 4635.84 4638.70 4647.09 4648.50 4651.42 4659.00 4663.61 4675.04 4679.06 4684.08 4696.27 4702.14 4711.59 4715.42 4722.11 4732.62 4733.10 4734.73 4761.28 4774.72 4829.47 4829.60 4833.30 4848.93 4860.65 4861.20 4950.30 4976.85 5023.37 5314.49 5571.77 0.718853 0.750715 0.751660 0.648968 -1575.725444 -1575.693581 -1575.692637 -1575.795328 3.444273D-04 MUNgauss RevisionA2.0 retrievium 07-Feb-2020 DUDE CCCC[NH+](CCNC(=O)[C@@H]1CCCN(C1)c2c3c(ncn2)n4c(n3)CCCCC4)Cc5ccco5 C09211116 RHF 6-31G(d) (6D,10F) C1 494.324349 |X|Y|Z| 29.513178 59.684078 175.886694 67.665789 31 6 7 8 23 7 1 |36.858105| |12.469154|36.858105| |7.493967|12.423897|36.858105| |4.897646|7.552986|12.495154|36.858105| |3.761961|4.914186|7.552540|12.618802|53.358707| |3.808624|4.743208|7.455044|9.324980|25.714968|0.500000| |3.404673|4.184476|5.952980|7.590968|17.234774|0.257531|36.858105| |2.896830|3.321882|4.473123|5.002023|10.317261|0.210199|12.384319|36.858105| |2.463513|2.766317|3.472515|3.845090|6.977495|0.135613|7.745938|13.265597|53.358707| |2.191622|2.479589|3.013773|3.462780|6.158243|0.116404|6.078918|7.864840|19.041911|36.858105| |2.204349|2.541978|3.092659|3.722485|6.828079|0.125814|6.164951|7.078248|11.648947|15.789873|73.516695| |1.913224|2.118724|2.481559|2.761733|4.566315|0.087681|4.240161|5.050775|10.682908|12.598862|14.035059|36.858105| |1.863201|2.029694|2.374639|2.570668|4.214536|0.083132|3.868670|4.838511|10.154191|9.027153|10.696054|17.536434|0.500000| |1.704231|1.884579|2.165080|2.426764|3.936120|0.075972|3.398662|3.857616|6.912513|7.497476|11.835070|12.430841|0.245607|36.858105| |1.534348|1.672552|1.883242|2.066450|3.237163|0.062962|2.752998|3.049407|5.256419|4.906878|7.768046|7.568968|0.191069|12.414065|36.858105| |1.547351|1.684317|1.876088|2.047647|3.137816|0.060319|2.705520|2.890373|4.963452|4.403776|6.882416|6.526894|0.162316|7.489050|12.432991|36.858105| |1.696590|1.843800|2.071150|2.239799|3.441110|0.065944|3.081607|3.316294|5.958340|5.048537|7.328722|7.788391|0.200164|6.569851|7.739498|13.022438|53.358707| |1.920642|2.124022|2.438481|2.692609|4.252125|0.079988|3.999791|4.309125|8.381449|7.599750|10.115349|12.339211|0.248299|7.591991|6.587847|7.886956|17.949339|36.858105| |1.651902|1.765572|1.974291|2.082586|3.166499|0.061683|2.819384|3.087918|5.439422|4.224187|6.118799|5.913380|0.179248|4.903787|5.757198|7.691250|18.989274|7.877999|36.858105| |1.482535|1.568134|1.727943|1.806044|2.703653|0.053106|2.335124|2.530006|4.235335|3.264048|4.954505|4.267834|0.128879|3.929419|4.898462|6.339162|10.572275|5.085115|13.560640|36.858105| |1.449272|1.513199|1.659366|1.705132|2.530637|0.050212|2.169570|2.359795|3.855814|2.853429|4.359460|3.520182|0.108964|3.189327|3.732375|4.368786|7.095917|3.993654|8.061448|13.792275|36.858105| |1.537675|1.592561|1.753333|1.776957|2.635430|0.052641|2.277346|2.502157|4.069623|2.890167|4.365190|3.444007|0.109018|2.989399|3.297597|3.697815|6.231989|3.839221|6.806604|7.865312|14.339433|53.358707| |1.710937|1.783472|1.991527|2.021580|3.033735|0.060410|2.693300|3.004555|5.053203|3.489152|5.096786|4.180653|0.135636|3.395185|3.592855|4.013202|7.341870|4.750454|8.283493|7.212634|8.731124|19.846565|36.858105| |1.791467|1.901208|2.147061|2.227260|3.398131|0.066719|3.093523|3.465149|6.198840|4.415353|6.197830|5.712087|0.185708|4.319777|4.524102|5.248601|11.218912|7.097835|14.281918|8.130383|7.243155|10.935341|14.343969|53.358707| |1.315212|1.368007|1.484912|1.524669|2.242628|0.044592|1.885566|2.027915|3.230725|2.415698|3.790172|2.912292|0.088011|2.763757|3.280409|3.774608|5.581999|3.224624|5.441902|8.685793|13.996684|10.769034|5.448806|6.524293|53.358707| |1.276248|1.337725|1.449755|1.505758|2.217352|0.043836|1.854631|1.978490|3.157579|2.427915|3.855565|2.974965|0.087604|2.939616|3.657894|4.358589|5.975117|3.317637|5.418097|8.970213|8.716664|7.443797|4.417529|5.899005|18.820720|36.858105| |1.355748|1.434494|1.565268|1.643541|2.440941|0.047914|2.063872|2.203579|3.592414|2.826216|4.444084|3.607015|0.104771|3.592468|4.711164|6.153391|8.231600|4.156192|7.416984|13.798483|8.447800|7.320239|4.773361|7.021275|11.671181|14.805623|53.358707| |1.163110|1.216396|1.307302|1.357774|1.984300|0.039290|1.632867|1.725585|2.697497|2.081829|3.380388|2.483167|0.071875|2.524732|3.101710|3.560104|4.632367|2.708053|3.856466|5.319206|5.234778|5.305425|3.285498|4.403471|10.184623|12.677955|10.574624|36.858105| |1.111313|1.153887|1.230164|1.266919|1.832440|0.036361|1.499024|1.571338|2.419101|1.836371|2.998582|2.132414|0.061605|2.130134|2.510248|2.843909|3.831008|2.328766|3.187269|4.144061|4.429794|4.832711|2.956936|3.835942|8.575931|7.470408|7.037919|12.424831|36.858105| |1.078354|1.112127|1.185811|1.211959|1.753139|0.035032|1.428369|1.508847|2.306065|1.729495|2.820975|1.984474|0.058156|1.966038|2.274079|2.488941|3.405650|2.120894|2.867856|3.627752|4.135000|4.763778|2.857954|3.589182|7.974055|5.761880|5.658838|7.408845|12.414294|36.858105| |1.137994|1.171302|1.257578|1.280399|1.864612|0.037423|1.528993|1.636767|2.519295|1.872375|3.017441|2.161067|0.064663|2.109548|2.432288|2.624484|3.674411|2.285320|3.207101|4.121617|5.108963|5.945504|3.388881|4.098804|10.397764|6.226303|6.039870|6.404135|7.366982|12.410826|36.858105| |1.243884|1.281068|1.380546|1.402522|2.044938|0.040923|1.699618|1.821581|2.836671|2.086528|3.312683|2.428805|0.073248|2.304770|2.642357|2.928151|4.288905|2.630121|3.947517|5.280056|7.648272|8.707758|4.468362|5.128040|17.714549|7.384790|7.114473|6.002750|6.355086|7.394963|12.485224|36.858105| |3.013172|3.806083|4.963192|7.573563|17.017466|0.257993|7.658511|5.935224|6.249737|4.574296|10.107311|3.390067|0.084685|3.075876|2.479278|2.356135|3.405362|3.075633|2.252014|1.935741|1.788020|2.489398|2.078083|3.194846|2.176427|1.603144|2.415471|1.445854|1.326350|1.263210|1.335623|1.451096|36.858105| 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|2.705976|3.200641|3.620418|4.276589|6.056865|0.130102|3.334459|3.072975|3.516857|2.556143|5.163904|2.137874|0.056103|2.052713|1.762103|1.666789|2.341140|1.967468|1.600625|1.436027|1.356587|1.886818|1.525551|2.252327|1.694339|1.246002|1.832647|1.150036|1.070140|1.031764|1.083903|1.155526|5.342886|8.778785|8.607163|14.224331|36.858105| |3.073969|3.840246|4.519914|5.934273|8.330873|0.169861|4.179353|3.621931|4.040562|2.918860|5.975907|2.382654|0.061738|2.249071|1.907702|1.819496|2.581691|2.208574|1.751267|1.553782|1.460507|2.034389|1.659620|2.473181|1.811330|1.331761|1.970567|1.221542|1.134515|1.089084|1.144743|1.228660|7.833640|14.094782|8.619515|8.616472|14.158295|73.516695| |17.549813|8.771081|6.786492|4.512401|4.950262|0.102051|3.474723|2.990064|3.493671|2.248372|3.950814|1.975258|0.053787|1.739476|1.573042|1.596122|2.407307|2.000065|1.737095|1.555995|1.529978|2.227974|1.829761|2.591849|1.881467|1.332914|1.923952|1.209258|1.157929|1.125207|1.191220|1.309513|2.875514|2.675778|2.341625|2.237513|2.455910|4.945800|0.500000| |17.551259|8.772866|6.787175|4.523877|4.960513|0.106681|3.233123|2.843889|3.260508|2.128787|3.814835|1.855463|0.050527|1.660637|1.493470|1.492213|2.215921|1.835955|1.590205|1.432049|1.403844|2.029363|1.654334|2.347850|1.737651|1.237391|1.784612|1.129664|1.078759|1.051104|1.111906|1.210773|2.948816|2.894208|2.550516|2.512716|2.813529|5.554190|0.301289|0.500000| 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|8.857422|17.533197|8.848455|6.974256|6.258634|0.124021|3.740880|3.027007|3.456507|2.327101|4.315013|1.994030|0.052874|1.803196|1.600310|1.601816|2.356302|1.982756|1.649271|1.473525|1.417747|2.016379|1.646577|2.391137|1.755467|1.267803|1.849322|1.159594|1.099421|1.059330|1.111957|1.208633|3.798049|3.675669|3.019073|2.970455|3.548703|7.558069|0.172915|0.210785|0.213353|0.303586|0.500000| |6.889154|8.847683|17.507174|8.886593|9.420734|0.222591|5.256316|4.353504|4.525145|2.882463|5.272020|2.375681|0.063898|2.090500|1.818299|1.788388|2.667106|2.285481|1.879795|1.655682|1.597645|2.301513|1.911643|2.783437|1.952369|1.397818|2.045580|1.263810|1.189284|1.152512|1.225699|1.339238|4.771981|4.564963|3.763528|3.497322|3.929890|8.444123|0.169201|0.204396|0.140828|0.173672|0.211984|0.500000| |6.901948|8.860777|17.544972|8.795199|9.342208|0.187842|6.528734|4.933758|5.212987|3.198855|5.644208|2.641557|0.070842|2.252937|1.966294|1.974364|3.019157|2.625230|2.135070|1.854742|1.790116|2.602293|2.196169|3.215295|2.161916|1.539126|2.261962|1.377518|1.297232|1.251687|1.333748|1.475783|4.476697|3.827739|3.174924|2.851332|3.099475|6.671394|0.204735|0.169537|0.141004|0.212102|0.173843|0.302729|0.500000| |4.509099|6.812272|8.748844|17.607757|12.411845|0.183016|7.357431|4.660037|5.190983|3.505090|6.667076|2.835547|0.072257|2.485553|2.126881|2.143564|3.206649|2.851525|2.169457|1.873450|1.757381|2.480729|2.075780|3.138490|2.136298|1.556127|2.322412|1.401532|1.307800|1.243172|1.307745|1.437473|6.629851|4.933588|3.692727|3.232479|3.656624|8.698961|0.118733|0.110822|0.108251|0.205088|0.170999|0.172936|0.208395|0.500000| |4.554052|6.882377|8.856001|17.672387|12.388696|0.213772|5.625258|4.151593|4.497630|3.085136|6.031010|2.503998|0.064758|2.262026|1.935862|1.904493|2.785327|2.421066|1.899443|1.666217|1.572756|2.215303|1.829944|2.729904|1.931593|1.408464|2.085997|1.280359|1.196003|1.144903|1.204671|1.309705|7.521949|6.790425|4.680197|4.251781|5.255113|14.120790|0.111484|0.120417|0.109115|0.170685|0.208832|0.213869|0.173213|0.301741|0.500000| |3.875046|4.739835|6.842042|7.545718|12.303503|0.206437|17.666713|8.766383|8.745370|4.943495|8.424331|3.773020|0.098135|3.022246|2.539339|2.556910|4.031235|3.756787|2.773741|2.309441|2.175451|3.149507|2.747809|4.224085|2.568015|1.837908|2.762247|1.615519|1.496401|1.428747|1.530044|1.712195|5.647670|4.163153|3.436815|2.879656|2.989854|6.531334|0.113654|0.099511|0.090666|0.132462|0.111525|0.156542|0.239872|0.213802|0.148326|0.500000| |3.036033|3.735127|4.864497|6.485314|12.438302|0.183873|17.679730|8.785576|10.179362|6.827482|12.977636|4.702021|0.112858|3.776884|3.007266|2.992117|4.625925|4.573809|3.000139|2.457649|2.238960|3.146394|2.726977|4.367139|2.648549|1.937727|2.971810|1.704750|1.555496|1.467547|1.560976|1.735596|7.600078|4.813901|3.888634|3.108214|3.169940|7.062045|0.085526|0.079177|0.074263|0.106381|0.094910|0.118109|0.142747|0.198212|0.142784|0.302005|0.500000| |2.714911|3.111805|4.131667|4.732391|10.141063|0.224356|8.800462|17.578384|12.569524|7.280007|13.343628|4.713493|0.125292|3.848723|2.993929|2.748867|4.135307|3.832664|2.811230|2.349623|2.187843|3.118533|2.690091|4.175076|2.594822|1.874615|2.832828|1.652014|1.500891|1.444915|1.563608|1.718718|6.671022|5.319122|4.972525|3.701114|3.441590|7.126734|0.076192|0.075391|0.065819|0.082066|0.081069|0.116519|0.119450|0.118436|0.115159|0.175511|0.195864|0.500000| |3.052900|3.381445|4.581655|4.644065|8.639412|0.193455|8.817587|17.601588|12.610832|5.793896|9.093943|4.268438|0.120212|3.324168|2.744240|2.625809|4.125605|3.767679|2.931766|2.438813|2.329291|3.432198|3.033778|4.600193|2.723858|1.923872|2.875897|1.677966|1.541220|1.493775|1.630725|1.819817|4.779740|3.950840|3.619755|2.961306|2.875743|5.886388|0.089222|0.084303|0.072566|0.089031|0.084171|0.127653|0.146806|0.117627|0.107152|0.224572|0.175478|0.302845|0.500000| |2.372308|2.598740|3.193843|3.382740|5.766975|0.114708|6.034297|9.000578|26.040842|9.311948|10.882466|7.475009|0.228133|4.747754|3.845219|3.710946|6.341213|6.290047|4.507937|3.441197|3.183884|4.704821|4.476780|7.532985|3.547223|2.497926|3.853420|2.100481|1.885471|1.806744|1.998242|2.282407|3.744005|3.070603|2.883882|2.393597|2.306546|4.632831|0.069686|0.064091|0.058690|0.071842|0.065793|0.085224|0.099788|0.093654|0.081195|0.156210|0.159333|0.186399|0.231178|0.500000| |1.722994|1.927453|2.203107|2.520505|4.066885|0.077043|3.455312|3.726394|6.356793|6.933954|12.655971|8.875883|0.173960|17.552202|8.807247|6.661108|7.756716|6.846328|4.199525|3.446625|2.827520|3.611238|2.982671|5.068675|3.395336|2.674322|4.406677|2.345201|2.001745|1.834804|1.937805|2.104959|3.279960|2.787041|2.710998|2.265117|2.144124|4.208811|0.048519|0.046432|0.044385|0.054431|0.051550|0.058650|0.062984|0.072541|0.065754|0.084490|0.110306|0.103946|0.087756|0.116938|0.500000| |1.666481|1.836364|2.117720|2.365936|3.878260|0.076275|3.254901|3.804118|6.536684|6.796417|11.461624|8.799031|0.212621|17.559481|8.799918|5.474792|6.703667|5.504398|4.064445|3.413540|2.882700|3.731802|3.073403|5.088917|3.456354|2.671047|4.301114|2.334796|1.986404|1.861357|2.005811|2.160330|3.074996|2.713869|2.745563|2.288191|2.113896|4.062951|0.047027|0.045506|0.042737|0.051013|0.049099|0.057600|0.060741|0.066134|0.061867|0.079605|0.097674|0.110166|0.091714|0.123472|0.303973|0.500000| |1.437468|1.566167|1.747725|1.922132|2.981719|0.058094|2.470834|2.689292|4.440362|4.068100|6.843884|5.511630|0.139977|8.825343|17.546928|8.849747|7.643443|4.950817|4.466287|4.094492|3.232572|3.877980|3.017376|4.933311|4.036238|3.373595|5.734609|2.996440|2.424597|2.188971|2.299921|2.436082|2.320925|2.076113|2.065725|1.797946|1.702045|3.247827|0.040706|0.038942|0.037426|0.044158|0.041946|0.047024|0.050197|0.054885|0.050613|0.063297|0.074860|0.074582|0.067516|0.088923|0.215968|0.209658|0.500000| |1.493667|1.611865|1.815853|1.962534|3.071360|0.060601|2.605648|2.954949|5.082928|4.499297|6.948995|6.731867|0.199897|8.821438|17.518582|8.875503|9.366215|5.670632|6.009731|5.349619|4.138435|4.944232|3.902006|6.520702|4.922535|3.976719|6.861813|3.309779|2.645438|2.436354|2.666254|2.889773|2.317163|2.066586|2.058107|1.785538|1.687389|3.222461|0.042691|0.040580|0.038657|0.045220|0.042749|0.049070|0.052907|0.055574|0.051024|0.067366|0.077147|0.080699|0.075495|0.106693|0.173366|0.215898|0.303220|0.500000| |1.557184|1.708819|1.891529|2.089895|3.175013|0.060297|2.714028|2.807488|4.703979|4.220860|6.907589|5.744930|0.134633|6.725292|8.818561|17.545076|12.558566|7.215019|5.807477|4.936207|3.642949|4.310424|3.429765|5.929193|4.408477|3.722425|6.758015|3.186183|2.616591|2.276431|2.349876|2.594106|2.416205|2.088730|2.001471|1.746393|1.696883|3.309408|0.044412|0.041524|0.040646|0.049121|0.045319|0.049748|0.054910|0.061450|0.054227|0.071057|0.085112|0.074339|0.070091|0.094991|0.194407|0.138032|0.214900|0.173802|0.500000| |1.438147|1.550873|1.709592|1.843698|2.785853|0.053974|2.365667|2.517235|4.201197|3.564861|5.663976|4.897579|0.130695|5.472708|8.782515|17.716799|12.412614|5.702628|7.255652|7.312343|4.811639|5.217897|3.934122|6.596933|5.913715|5.427224|11.472455|4.382020|3.325755|2.828941|2.948643|3.262691|2.080166|1.837880|1.786289|1.576273|1.524147|2.933580|0.041258|0.038583|0.037599|0.044274|0.041036|0.045426|0.049941|0.053460|0.047879|0.062913|0.071535|0.066753|0.064755|0.088500|0.137552|0.122973|0.210106|0.215809|0.303317|0.500000| |2.076739|2.288603|2.641906|2.869337|4.489908|0.084322|4.395920|4.682480|9.199270|6.991955|9.189384|8.705127|0.211356|5.500600|4.888852|5.702766|12.527083|17.706112|7.464965|4.838211|4.032058|5.564817|5.353486|11.160070|4.343736|3.164318|5.209006|2.574135|2.265783|2.084784|2.261492|2.646957|3.107670|2.540963|2.352362|2.007450|1.974032|3.966177|0.060813|0.054790|0.052853|0.065938|0.058494|0.068101|0.080759|0.084901|0.070322|0.119337|0.137087|0.109908|0.116293|0.206310|0.140922|0.122700|0.108169|0.125532|0.147713|0.127765|0.500000| |1.929046|2.162121|2.460213|2.779500|4.336737|0.079835|4.006426|4.040959|7.275984|6.830796|10.332215|8.823434|0.174702|7.014780|5.967743|7.316820|12.610312|17.538742|5.847616|4.257159|3.401813|4.402278|3.823841|7.072129|3.897460|3.007248|5.070785|2.532694|2.196152|1.982539|2.094672|2.373283|3.218155|2.617673|2.422589|2.059222|2.021649|4.067588|0.055354|0.050908|0.049609|0.062618|0.056424|0.063402|0.072601|0.083383|0.069862|0.103540|0.133742|0.101413|0.096416|0.141505|0.207835|0.141832|0.134145|0.134682|0.224255|0.147867|0.301848|0.500000| |1.812176|1.870654|2.096470|2.092091|3.129322|0.062863|2.786762|3.132544|5.147721|3.387230|4.963230|3.828865|0.123800|3.076238|3.126760|3.378439|5.965469|4.196442|5.870060|5.126168|6.020521|12.790775|17.710970|12.735765|5.884134|3.570804|5.118860|2.800245|2.589793|2.552630|3.006997|3.843159|2.102977|1.859032|1.783651|1.585323|1.551511|3.002106|0.054328|0.048754|0.046495|0.052734|0.047625|0.056054|0.064980|0.059276|0.052282|0.080329|0.076676|0.076985|0.090512|0.129625|0.075976|0.078907|0.074122|0.093312|0.082590|0.090658|0.135643|0.095973|0.500000| |1.158023|1.216983|1.305240|1.364590|1.990957|0.039228|1.634425|1.712192|2.673820|2.089251|3.422572|2.495028|0.070797|2.582203|3.208946|3.772312|4.724323|2.749308|3.752699|4.957167|4.505091|4.686602|3.028226|4.198704|7.750902|9.179715|10.265930|17.609340|8.793945|5.477822|4.707620|4.587229|1.460771|1.333350|1.305167|1.188687|1.158857|2.191253|0.033343|0.031177|0.030706|0.034714|0.032305|0.034952|0.038065|0.039288|0.035827|0.044771|0.047780|0.045619|0.045886|0.057233|0.067592|0.065753|0.087753|0.092461|0.095952|0.132388|0.071638|0.072794|0.072134|0.500000| |1.126360|1.176993|1.267429|1.316554|1.931627|0.038421|1.580119|1.682766|2.621642|2.029526|3.309416|2.414817|0.070449|2.494234|3.077304|3.371701|4.297699|2.556696|3.529693|4.680710|4.633091|4.874408|3.054732|4.093438|8.556912|8.966015|8.710081|17.517549|8.804331|7.056119|6.428964|5.395228|1.413716|1.301081|1.284884|1.171830|1.135463|2.133910|0.032448|0.030509|0.029799|0.033330|0.031253|0.034204|0.036984|0.037550|0.034599|0.043199|0.045642|0.045111|0.045494|0.056543|0.063932|0.065125|0.083840|0.093136|0.083276|0.113884|0.067048|0.066271|0.073249|0.304398|0.500000| |1.148903|1.192032|1.267688|1.302802|1.875742|0.037110|1.541212|1.604609|2.470463|1.863324|3.033328|2.155334|0.061975|2.119395|2.467103|2.855400|3.947887|2.401280|3.313614|4.290081|4.656047|5.118439|3.118205|4.016898|8.785446|7.132439|7.015481|8.865388|17.530979|8.796945|6.333533|6.493044|1.350158|1.234525|1.201566|1.101975|1.082348|2.047663|0.033353|0.030870|0.030567|0.034073|0.031456|0.033905|0.037256|0.037510|0.034058|0.043006|0.044484|0.042278|0.043774|0.053646|0.055600|0.054438|0.065457|0.071340|0.073617|0.091695|0.065699|0.063028|0.075760|0.203711|0.174010|0.500000| |1.056783|1.097774|1.165153|1.202149|1.731888|0.034338|1.406315|1.464816|2.236972|1.705435|2.813850|1.961564|0.056081|1.982582|2.323094|2.611373|3.453365|2.131544|2.784785|3.472295|3.577286|4.035402|2.550727|3.363662|6.355258|5.549572|5.851049|8.883374|17.563037|8.884977|5.471130|4.690181|1.259711|1.161608|1.138021|1.048108|1.026180|1.929588|0.030493|0.028498|0.028178|0.031282|0.029153|0.031298|0.033981|0.034493|0.031656|0.038936|0.040608|0.039036|0.039815|0.048015|0.052318|0.051560|0.063355|0.067163|0.068022|0.084317|0.057364|0.056630|0.062994|0.224012|0.203022|0.305343|0.500000| |1.056058|1.084683|1.150754|1.170708|1.682765|0.033639|1.367172|1.435538|2.176346|1.619794|2.650222|1.834962|0.053549|1.803050|2.050008|2.245716|3.110569|1.968850|2.603230|3.197115|3.665114|4.404389|2.667187|3.322902|6.655226|4.621073|4.812923|5.483445|8.885636|17.537505|8.844123|6.414726|1.207820|1.118384|1.097217|1.013691|0.992782|1.862454|0.030655|0.028570|0.028138|0.030779|0.028684|0.031047|0.033761|0.033380|0.030730|0.038188|0.038922|0.038109|0.039634|0.047338|0.047066|0.047459|0.054768|0.060388|0.057766|0.069752|0.054316|0.051404|0.067314|0.123439|0.141263|0.223018|0.207800|0.500000| |1.026600|1.058843|1.128113|1.154609|1.671161|0.033462|1.352411|1.430156|2.174314|1.638129|2.691027|1.870764|0.054709|1.878086|2.171944|2.332025|3.131846|1.970333|2.583767|3.188572|3.511751|4.116091|2.538100|3.234175|6.364096|4.812468|4.998047|6.413054|8.844466|17.537462|8.904141|5.484178|1.210355|1.125152|1.111184|1.025575|0.998760|1.866743|0.029660|0.027866|0.027308|0.029941|0.028111|0.030549|0.032942|0.032812|0.030418|0.037423|0.038567|0.038297|0.039283|0.047031|0.048792|0.049838|0.058857|0.064744|0.059520|0.073427|0.053417|0.051439|0.063624|0.139675|0.193376|0.174695|0.224369|0.304461|0.500000| |1.106396|1.132407|1.212715|1.227230|1.781373|0.035904|1.453172|1.556264|2.370900|1.745692|2.823307|1.983636|0.059453|1.926468|2.178021|2.314077|3.260417|2.076589|2.814087|3.453381|4.254159|5.333716|3.098339|3.703091|7.680994|4.631912|4.873435|4.714785|5.468626|8.882082|17.554181|8.960440|1.271731|1.180262|1.164931|1.072591|1.043951|1.954119|0.032199|0.030100|0.029302|0.031899|0.029868|0.032935|0.035725|0.034701|0.032115|0.040515|0.040948|0.041367|0.043369|0.052246|0.049310|0.051339|0.057344|0.066126|0.058087|0.070783|0.057564|0.053013|0.078666|0.103643|0.133708|0.137774|0.123829|0.224275|0.208396|0.500000| 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